1 174   1   0  0.9040447E+01  0.1000000E-03
  CAR 
 LKU21-SHH-V2, Si31C26O39H78 , Relax atom
   0   0   0
   1   1
 256 256 256
 256
  0.1000000E-09
  0.6250000E-11
   1
  0.5000000E-15  0.1163000E-08  0.1163000E-08  0.1163000E-08